Delstaphinine
TL;DR: Delstaphinine (CAS 111537-46-3) is a chemical compound with molecular formula C24H37NO6 and molecular weight 435.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethyl-12,16-dimethoxy-10-(methoxymethyl)-6-oxa-4-azaheptacyclo[15.2.1.02,7.02,11.03,13.05,10.014,19]icosane-14,18-diol
Also Known As: Delstaphinine, 20-Ethyl-6,16-dimethoxy-4-(methoxymethyl)-1,19-epoxyaconitane-8,14-diol
| Molecular Formula | C24H37NO6 |
|---|---|
| Molecular Weight | 435.26 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 80.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 435.2621 |
| Heavy Atoms | 31 |
| Complexity | 796.0 |
Chemical Identifiers
| CAS Number | 111537-46-3 |
|---|---|
| SMILES | CCN1C2C3C(C4C2(C5CCC4(C1O5)COC)C6CC7C(CC3(C6C7O)O)OC)OC |
| InChIKey | PFHLCWUAGPPUIS-UHFFFAOYSA-N |
Product Overview
Delstaphinine (CAS 111537-46-3), with molecular formula C24H37NO6 and molecular weight 435.26 g/mol. IUPAC: 4-ethyl-12,16-dimethoxy-10-(methoxymethyl)-6-oxa-4-azaheptacyclo[15.2.1.02,7.02,11.03,13.05,10.014,19]icosane-14,18-diol.
Chemical Property Profile of Delstaphinine
Property Insights of Delstaphinine
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Delstaphinine. The TPSA of 80.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Delstaphinine. Following Lipinski's Rule of Five, Delstaphinine has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Delstaphinine?
The CAS number of Delstaphinine is 111537-46-3.
What is the molecular formula of Delstaphinine?
The molecular formula of Delstaphinine is C24H37NO6.
What is the molecular weight of Delstaphinine?
The molecular weight of Delstaphinine is 435.26 g/mol.
Where can I buy Delstaphinine?
You can request a quote for Delstaphinine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Delstaphinine?
Yes, KEHONG BIO provides custom synthesis services for Delstaphinine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.